Basic information
- Standard SMILES
COC(CC[C@H](N)CO)c1ccc(Cl)cc1- InChIKey
AHWMCAMJXFULMV-PXYINDEMSA-N- Molecular formula
- C12H18ClNO2
- Average molar mass
- 243.73 g/mol
Names & identifiers
- Preferred name
- (S)-2-amino-5-(4-chloro-phenyl)-5-methoxy-pentan-1-ol
- IUPAC
- (2S)-2-amino-5-(4-chlorophenyl)-5-methoxypentan-1-ol
Names & synonyms
SCHEMBL1836675AHWMCAMJXFULMV-PXYINDEMSA-N(S)-2-amino-5-(4-chloro-phenyl)-5-methoxy-p entan-1-ol(S)-2-amino-5-(4-chloro-phenyl)-5-methoxy-pentan-1-ol
Database identifiers
- PubChem CID
- 59173183
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 55.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 184
Related reactions
6 records
Compound notes
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